SCHEMBL6260549

SCHEMBL6260549

O=P(O)(O)C(F)(F)c1ccc(Nc2ccccc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 3/20 0.68
▸ PGK1 P00558 3/20 0.67
▸ PGK2 P07205 3/20 0.67
▸ PTPN5 P54829 1/20 0.65
▸ PTPN2 P17706 1/20 0.51
▸ PTPN6 P29350 1/20 0.51
▸ PTPN11 Q06124 1/20 0.51

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6428108 0.82 PTPN1 (1.00) PTPN1PGK1PGK2PTPN5PTPN2
Diphenylamine SCHEMBL27245439 0.77 HSD17B10 (0.67) —
Diphenylamine SCHEMBL27245440 0.77 HSD17B10 (0.67) —
Diphenylamine SCHEMBL28255754 0.77 HSD17B10 (0.67) —
SCHEMBL503225 0.76 ALDH1A1 (0.62) —
Hydrochloric Acid SCHEMBL2846563 0.74 ALDH1A1 (0.59) —
Fluoride SCHEMBL8754786 0.74 ALDH1A1 (0.59) —
SCHEMBL17115744 0.73 NPC1 (0.81) —
SCHEMBL6838700 0.72 PGK1 (0.78) PTPN1PGK1PGK2PTPN5PTPN2
SCHEMBL2637465 0.72 PGK1 (0.78) PTPN1PGK1PGK2PTPN5PTPN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1523323-A2 REAGENTS AND METHODS FOR SMOOTH MUSCLE THERAPIES Arizona Board of Regents (US) 2005-04-20 — — EP disclosed
WO-2003018758-A2 REAGENTS AND METHODS FOR SMOOTH MUSCLE THERAPIES ARIZONA BOARD OF REGENTS (US) 2003-03-06 — — WO disclosed
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